6-[(2R)-2-[(2-chloranyl-4-fluoranyl-phenoxy)methyl]pyrrolidin-1-yl]-7H-purine

Systemtic Name: 6-[(2R)-2-[(2-chloranyl-4-fluoranyl-phenoxy)methyl]pyrrolidin-1-yl]-7H-purine Openeye Name: 6-[(2R)-2-[(2-chloro-4-fluoro-phenoxy)methyl]pyrrolidin-1-yl]-7H-purine CAS Name: 6-[(2R)-2-[(2-chloro-4-fluorophenoxy)methyl]-1-pyrrolidinyl]-7H-purine IUPAC Name: 6-[(2R)-2-[(2-chloro-4-fluorophenoxy)methyl]pyrrolidin-1-yl]-7H-purine Traditional Name: 6-[(2R)-2-[(2-chloro-4-fluoro-phenoxy)methyl]pyrrolidino]-7H-purine Formula: C16H15ClFN5O MolecularWeight: 347.774603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC=NC3=C2NC=N3)COC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1C[C@@H](N(C1)C2=NC=NC3=C2NC=N3)COC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C16H15ClFN5O/c17-12-6-10(18)3-4-13(12)24-7-11-2-1-5-23(11)16-14-15(20-8-19-14)21-9-22-16/h3-4,6,8-9,11H,1-2,5,7H2,(H,19,20,21,22)/t11-/m1/s1